SCHEMBL1277672

SCHEMBL1277672

COc1ccc(CSCC(COC(=O)C(C)(C)C)NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.60
PPARA Q07869 9/20 0.60
PPARD Q03181 2/20 0.47
ACE P12821 2/20 0.44
CACNA1B Q00975 2/20 0.43
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
GAA P10253 1/20 0.41
CTSK P43235 1/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
ATM Q13315 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1277670 1.00 PPARG (0.60) PPARGPPARAPPARDACECACNA1B
SCHEMBL3032276 0.86 PPARG (0.64) PPARGPPARAPPARDACECACNA1B
SCHEMBL3032280 0.86 PPARG (0.64) PPARGPPARAPPARDACECACNA1B
SCHEMBL1277769 0.86 PPARG (0.64) PPARGPPARAPPARDACECACNA1B
SCHEMBL1633974 0.85 PPARG (0.46) PPARGPPARAACEGAAALDH1A1
SCHEMBL1632949 0.85 PPARG (0.46) PPARGPPARAACEGAAALDH1A1
SCHEMBL10511874 0.84 PPARG (0.62) PPARGPPARAPPARDACECACNA1B
SCHEMBL1277888 0.84 PPARG (0.62) PPARGPPARAPPARDACECACNA1B
SCHEMBL1277885 0.84 PPARG (0.62) PPARGPPARAPPARDACECACNA1B
SCHEMBL1277844 0.81 PPARG (0.74) PPARGPPARAPPARDACECACNA1B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088760-A1 GLUCOKINASE ACTIVATORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE INGREDIENT LG CHEM, LTD. (KR) 2012-04-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120088760-A1 GLUCOKINASE ACTIVATORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS AN ACTIVE INGREDIENT GCKR, GCK, GALK1 PPARG 1086/4885PPARA 1986/4885PPARD 2900/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.